COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL234388
Chemical Name: ethyl4-(3-{1-cyano-2-[(3-methoxypropyl)amino]-2-oxoethyl}quinoxalin-2-yl)piperazine-1-carboxylate
Smiles: COCCCNC(=O)C(c1nc2ccccc2nc1N1CCN(CC1)C(=O)OCC)C#N

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Molecular Weight: 440.5
Empirical Formula: C22H28N6O4

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: -0.293
Rotatable bonds: 8
H-donors: 1
H-acceptors: 4
PSA: 120
Number of rings: 3

     

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